MEB55

CAT: 0931-T28010-02Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T28010-02Size:50 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1323359-63-2

Target

Apoptosis, Caspase, Others

Related Pathways

Apoptosis, Proteases/Proteasome, Others

Bioactivity

MEB55, an anticancer agent, acts by disrupting DNA repair and halting growth in prostate, colon, lung and breast cancer cells.

Smiles

CN1C2=C(C=3C1=CC(=CC3)C4=CC=CS4)C/C(=C\OC5C=C(C)C(=O)O5)/C2=O

Molecular Formula

C22H17NO4S

Molecular Weight

391.44

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

(2E)-4-methyl-2-[(4-methyl-5-oxo-2H-furan-2-yl)oxymethylidene]-6-thiophen-2-yl-1H-cyclopenta[b]indol-3-one

CAS Number	1323359-63-2
PubChem CID	54763243
IUPAC Name	(2E)-4-methyl-2-[(4-methyl-5-oxo-2H-furan-2-yl)oxymethylidene]-6-thiophen-2-yl-1H-cyclopenta[b]indol-3-one
Molecular Formula	C22H17NO4S
Molecular Weight	391.4
XLogP	4.2
Topological Polar Surface Area	85.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Heavy Atom Count	28
Formal Charge	0
Complexity	747

SMILES

CC1=CC(OC1=O)O/C=C/2\CC3=C(C2=O)N(C4=C3C=CC(=C4)C5=CC=CS5)C

InChI

InChI=1S/C22H17NO4S/c1-12-8-19(27-22(12)25)26-11-14-9-16-15-6-5-13(18-4-3-7-28-18)10-17(15)23(2)20(16)21(14)24/h3-8,10-11,19H,9H2,1-2H3/b14-11+

InChIKey

BTQWNMVZOCHXBS-SDNWHVSQSA-N

Chemical Structure

2D Structure

CAS: 1323359-63-2

CID: 54763243

Formula: C22H17NO4S

MW: 391.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	391.4
XLogP3	4.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	391.08782920
Monoisotopic Mass	391.08782920
Topological Polar Surface Area	85.8 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	747
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
MBS5777709	MEB55

MEB55

Chemical Information

Alternative Products

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